Crystallography Open Database

Information card for entry 4312208

Preview

Coordinates	4312208.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Mercury(I) monofluorophosphate
Formula	F Hg2 O3 P
Calculated formula	F Hg2 O3 P
Title of publication	Preparation and Characterization of Dimercury(I) Monofluorophosphate(V), Hg2PO3F: Crystal Structure, Thermal Behavior, Vibrational Spectra, and Solid-State 31P and 19F NMR Spectra
Authors of publication	Matthias Weil; Michael Puchberger; Enrique J. Baran
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	8330 - 8335
a	9.406 ± 0.002 Å
b	12.145 ± 0.003 Å
c	8.567 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	978.7 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	72
Hermann-Mauguin space group symbol	I b a m
Hall space group symbol	-I 2 2c
Residual factor for all reflections	0.0406
Residual factor for significantly intense reflections	0.0353
Weighted residual factors for significantly intense reflections	0.0879
Weighted residual factors for all reflections included in the refinement	0.0909
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179161 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/22.	4312208.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4312208.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4312208.cif
3713	2010-11-17	../uploads/cif-deposit/cod/cif Adding structures of 4312208 via cif-deposit CGI script.	4312208.cif